8015-9144 Screening compound: 1-(4-fluorophenyl)-1H-1,2,3,4-tetraazol-5-yl (1-methyl-3-nitro-1H-1,2,4-triazol-5-yl) sulfide

8015-9144 Screening compound: 1-(4-fluorophenyl)-1H-1,2,3,4-tetraazol-5-yl (1-methyl-3-nitro-1H-1,2,4-triazol-5-yl) sulfide
8015-9144 Screening compound: 1-(4-fluorophenyl)-1H-1,2,3,4-tetraazol-5-yl (1-methyl-3-nitro-1H-1,2,4-triazol-5-yl) sulfide alternative view

Chemical Structure Depiction of ChemDiv screening compound 8015-9144
1-(4-fluorophenyl)-1H-1,2,3,4-tetraazol-5-yl (1-methyl-3-nitro-1H-1,2,4-triazol-5-yl) sulfide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8015-9144

Molecular Formula

C10H7FN8O2S (C10 H7 FN8 O2 S)

Compound Name

1-(4-fluorophenyl)-1H-1,2,3,4-tetraazol-5-yl (1-methyl-3-nitro-1H-1,2,4-triazol-5-yl) sulfide

IUPAC name

1-(4-fluorophenyl)-5-[(1-methyl-3-nitro-1H-124-triazol-5-yl)sulfanyl]-1H-1234-tetrazole

SMILES

Cn(c(Sc1nnnn1-c(cc1)ccc1F)n1)nc1[N+]([O-])=O

InChI

InChI=1S/C10H7FN8O2S/c1-17-9(12-8(14-17)19(20)21)22-10-13-15-16-18(10)7-4-2-6(11)3-5-7/h2-5H,1H3

InChI Key

UUGLFIULZADCDX-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD05259158

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

322.28

Hydrogen Bond Acceptors Count

10.00

Hydrogen Bond Donors Count

0.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

10

Partition Coefficient, logP

1.609

Distribution Coefficient, logD

1.609

Water Solubility, LogSw

-2.10

Polar Surface Area

97.123

Acid Dissociation Constant (pKa)

28.03

Base Dissociation Constant (pKb)

-2.74

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

10.00

8015-9144 in Drug Discovery

Included in Screening Libraries

Akt-Targeted Library (14764 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic
  • Skin
Targets:
  • Kinases

References: we are preparing a list of scientific research reports with 8015-9144 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8015-9144?
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What is the minimum amount of 8015-9144 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8015-9144
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8015-9144
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8015-9144 available by request